SCHEMBL4767969

SCHEMBL4767969

COc1ccc(C(F)(F)F)cc1Oc1ccc(S(C)(=O)=O)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.52
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ALOX15 P16050 1/20 0.50
MAPK1 P28482 1/20 0.50
PTGS2 P35354 6/20 0.47
BRD4 O60885 1/20 0.47
HCRTR1 O43613 1/20 0.46
HCRTR2 O43614 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GAA P10253 1/20 0.44
ESRRA P11474 1/20 0.44
MAPT P10636 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1654842 0.86 PTGDR2 (0.54) PTGDR2KMT2AMEN1BRD4
SCHEMBL5390308 0.85 PTGDR2 (0.53) PTGDR2KMT2AMEN1BRD4
SCHEMBL586210 0.83 PTGDR2 (0.74) PTGDR2
SCHEMBL1651608 0.83 PTGDR2 (0.51) PTGDR2KMT2ABRD4
SCHEMBL1333614 0.82 PTGS2 (0.53) PTGDR2KMT2AMEN1PTGS2SMN1; SMN2
SCHEMBL11649824 0.80 FFAR1 (0.55) PTGDR2KMT2AMEN1PTGS2SMN1; SMN2
SCHEMBL585902 0.79 PTGDR2 (0.57) PTGDR2KMT2ABRD4
SCHEMBL1332131 0.79 PTGDR2 (0.55) PTGDR2KMT2ABRD4HCRTR1HCRTR2
SCHEMBL2396297 0.79 PTGDR2 (0.57) PTGDR2KMT2ABRD4
SCHEMBL8168262 0.78 PTGDR2 (0.53) PTGDR2KMT2APTGS2HCRTR1HCRTR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease ASTRAZENECA AB (SE) 2008-11-27 US disclosed
EP-1963259-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE AstraZeneca AB (SE) 2008-09-03 EP disclosed
WO-2007068894-A2 SUBSTITUTED DIPHENYLETHERS, -AMINES, -SULFIDES AND -METHANES FOR THE TREATMENT OF RESPIRATORY DISEASE ASTRAZENECA AB (SE) 2007-06-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080293775-A1 Substituted Diphenylethers, -Amines, -Sulfides and -Methanes for the Treatment of Respiratory Disease PNMT, SQOR, SMS PTGDR2 120/4885KMT2A 1651/4885MEN1 973/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.